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Assay Detail

CHEMBL5733274

Review assay metadata, readout intent, target linkage, and publication context from the same page.

Binding
p38 MAPKgamma Enzyme Inhibition: The inhibitory activities of compounds of the invention against p38MAPKγ (MAPK12: Invitrogen), were evaluated in a similar fashion to that described hereinabove. The enzyme (800 ng/mL, 2.5 μL) was incubated with the test compound (2.5 μL at either 4 μg/mL, 0.4 μg/mL, 0.04 μg/mL, or 0.004 μg/mL) for 2 hr at RT. The FRET peptides (8 μM, 2.5 μL), and appropriate ATP solution (2.5 μL, 400 μM) was then added to the enzymes/compound mixtures and incubated for 1 hr. Development reagent (protease, 5 μL) was added for 1 hr prior to detection in a fluorescence microplate reader (Varioskan® Flash, Thermo Scientific).
108
Total Activities
32
Compounds Tested
4
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Mitogen-activated protein kinase 12 (CHEMBL4674)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

1-pyrazolyl-3-(4-((2-anilinopyrimidin-4-yl) oxy) napththalen-1-yl) ureas as p38 MAP kinase inhibitors
(2019)

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
kon 36 - -
k_off 36 - -
IC50 34 6.07 6.58
Kd 2 7.84 8.30

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL3695569 6 8.30
CHEMBL3701217 6 7.37
CHEMBL5768918 3 6.58
CHEMBL5951223 3 6.55
CHEMBL5988695 3 6.37
CHEMBL5848716 3 6.27
CHEMBL5896412 6 6.25
CHEMBL5794070 3 6.16
CHEMBL6043284 3 5.82
CHEMBL5896806 3 5.77
CHEMBL6014943 3 5.09
CHEMBL5820343 3 -
CHEMBL5853055 3 -
CHEMBL6007304 3 -
CHEMBL5921712 3 -
CHEMBL5756167 3 -
CHEMBL5947021 3 -
CHEMBL6019442 3 -
CHEMBL5762929 3 -
CHEMBL5977979 3 -
CHEMBL6008491 3 -
CHEMBL5830994 3 -
CHEMBL5761911 3 -
CHEMBL5754667 3 -
CHEMBL5896751 6 -
CHEMBL5901318 3 -
CHEMBL5836383 3 -
CHEMBL5758982 3 -
CHEMBL6035491 3 -
CHEMBL6014353 3 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL3695569 Kd = 5.0 nM 8.30
CHEMBL3701217 Kd = 43.0 nM 7.37
CHEMBL5768918 IC50 = 264.0 nM 6.58
CHEMBL5951223 IC50 = 281.0 nM 6.55
CHEMBL3695569 IC50 = 344.0 nM 6.46
CHEMBL5988695 IC50 = 423.0 nM 6.37
CHEMBL5848716 IC50 = 535.0 nM 6.27
CHEMBL5896412 IC50 = 557.0 nM 6.25
CHEMBL5794070 IC50 = 695.0 nM 6.16
CHEMBL5896412 IC50 = 760.0 nM 6.12
CHEMBL6043284 IC50 = 1503.0 nM 5.82
CHEMBL5896806 IC50 = 1702.0 nM 5.77
CHEMBL3701217 IC50 = 3739.0 nM 5.43
CHEMBL6014943 IC50 = 8198.0 nM 5.09
CHEMBL5951223 k_off = - s-1 -
CHEMBL5921712 IC50 > 15800.0 nM -
CHEMBL5830994 IC50 > 1630.0 nM -
CHEMBL5830994 kon = - -
CHEMBL5836383 IC50 > 1580.0 nM -
CHEMBL3695569 k_off = - s-1 -
CHEMBL3695569 kon = - -
CHEMBL3701217 k_off = - s-1 -
CHEMBL3701217 kon = - -
CHEMBL5768918 k_off = - s-1 -
CHEMBL5768918 kon = - -
CHEMBL5758982 k_off = - s-1 -
CHEMBL5758982 kon = - -
CHEMBL5758982 IC50 > 1620.0 nM -
CHEMBL5836383 k_off = - s-1 -
CHEMBL5836383 kon = - -
CHEMBL5754667 IC50 > 1540.0 nM -
CHEMBL5754667 k_off = - s-1 -
CHEMBL5947021 k_off = - s-1 -
CHEMBL5754667 kon = - -
CHEMBL5896751 kon = - -
CHEMBL5896751 k_off = - s-1 -
CHEMBL5756167 IC50 > 16000.0 nM -
CHEMBL5756167 kon = - -
CHEMBL5756167 k_off = - s-1 -
CHEMBL5947021 IC50 > 1670.0 nM -
CHEMBL5947021 kon = - -
CHEMBL5951223 kon = - -
CHEMBL6019442 IC50 > 1590.0 nM -
CHEMBL6019442 kon = - -
CHEMBL6019442 k_off = - s-1 -
CHEMBL6014353 IC50 > 1660.0 nM -
CHEMBL6014353 kon = - -
CHEMBL6014353 k_off = - s-1 -
CHEMBL5794070 kon = - -
CHEMBL5794070 k_off = - s-1 -